Observation of a Polar Compound with Halide Ordering in the Compositional Series (CH <sub>3</sub> NH <sub>3</sub> ) <sub>2</sub> Te(Br <sub> <i>x</i> </sub> Cl <sub> 1– <i>x</i> </sub> ) <sub>6</sub>

Single-crystal samples of compounds in the series (CH<sub>3</sub>NH<sub>3</sub>)<sub>2</sub>Te(Cl<sub>1-<i>x</i></sub>Br<sub><i>x</i></sub>)<sub>6</sub> were produced with counter-diffusion crystal growth in silica gels, and new crystal structures are determined using single-crystal X-ray diffraction. With increasing Br content, the structure transitions from <i>P</i>3̅<i>m</i>1 to <i>P</i>6<sub>3</sub><i>mc</i> to <i>R</i>3̅<i>m</i> and finally to <i>Fm</i>3̅<i>m</i>. The compound with x≈0.068 adopts the polar <i>P</i>6<sub>3</sub><i>mc</i> space group, and the structure has partially ordered Cl<sup>-</sup> and Br<sup>-</sup> ions. The crystals of this compound show distinct piezoelectric domains with different responses by Piezoresponse Force Microscopy (PFM), confirming their polar structure.

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Publication Details

Journal
Inorganic Chemistry
Published
2025-10-22
DOI
https://doi.org/10.1021/acs.inorgchem.5c03380
Primary Topic
Solid-state spectroscopy and crystallography
Type
article
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article

Observation of a Polar Compound with Halide Ordering in the Compositional Series (CH 3 NH 3 ) 2 Te(Br x Cl 1– x ) 6

Prajna Bhatt, Anna Regoutz, Roxy Lee, Robert G. Palgrave et al.
Inorganic Chemistry
Solid-state spectroscopy and crystallography
article

Observation of a Polar Compound with Halide Ordering in the Compositional Series (CH 3 NH 3 ) 2 Te(Br x Cl 1– x ) 6

Prajna Bhatt, Anna Regoutz, Roxy Lee, Robert G. Palgrave, Robin Perry, Avishek Dey, Yuhan Liu
article en

Abstract

Single-crystal samples of compounds in the series (CH<sub>3</sub>NH<sub>3</sub>)<sub>2</sub>Te(Cl<sub>1-<i>x</i></sub>Br<sub><i>x</i></sub>)<sub>6</sub> were produced with counter-diffusion crystal growth in silica gels, and new crystal structures are determined using single-crystal X-ray diffraction. With increasing Br content, the structure transitions from <i>P</i>3̅<i>m</i>1 to <i>P</i>6<sub>3</sub><i>mc</i> to <i>R</i>3̅<i>m</i> and finally to <i>Fm</i>3̅<i>m</i>. The compound with x≈0.068 adopts the polar <i>P</i>6<sub>3</sub><i>mc</i> space group, and the structure has partially ordered Cl<sup>-</sup> and Br<sup>-</sup> ions. The crystals of this compound show distinct piezoelectric domains with different responses by Piezoresponse Force Microscopy (PFM), confirming their polar structure.

Inorganic ChemistryVol. 64(43)
London Centre for Nanotechnology (GB), University of Oxford (GB), Istituto Officina dei Materiali (IT), University College London (GB), Technical University of Denmark (DK)
Openalex Percentile: Top 76%
Solid-state spectroscopy and crystallography
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Observation of a Polar Compound with Halide Ordering in the Compositional Series (CH <sub>3</sub> NH <sub>3</sub> ) <sub>2</sub> Te(Br <sub> <i>x</i> </sub> Cl <sub> 1– <i>x</i> </sub> ) <sub>6</sub> — Prajna Bhatt, Anna Regoutz, et al. · Inorganic Chemistry (2025) | TGRS Research Map | TGRS